2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-(4-pentylphenyl)ethanamide

Systemtic Name: 2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-(4-pentylphenyl)ethanamide Openeye Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-(4-pentylphenyl)acetamide CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-(4-pentylphenyl)acetamide IUPAC Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-(4-pentylphenyl)acetamide Traditional Name: N-(4-amylphenyl)-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H23N3O2/c1-2-3-4-7-15-10-12-16(13-11-15)22-20(25)14-19-17-8-5-6-9-18(17)21(26)24-23-19/h5-6,8-13H,2-4,7,14H2,1H3,(H,22,25)(H,24,26)